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D7-Isovalerophenone
SpectraBase Compound ID 7s0QxHOSWRp
InChI InChI=1S/C11H14O/c1-9(2)8-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/i1D3,2D3,9D
InChIKey HEOVGVNITGAUKL-SCENNGIESA-N
Mol Weight 169.27 g/mol
Molecular Formula C11H7D7O
Exact Mass 169.148402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4fVY6Obyr6k
Name D7-Isovalerophenone
Alternate Name(s) 3-(methyl-d3)-1-phenylbutan-1-one-3,4,4,4-d4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H7D7O
InChI InChI=1S/C11H14O/c1-9(2)8-11(12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/i1D3,2D3,9D
InChIKey HEOVGVNITGAUKL-SCENNGIESA-N
Literature Reference DOI 10.1002/rcm.7603
Molecular Weight 169.275 g/mol
SMILES c1cc(ccc1)C(=O)CC(C([D])([D])[D])([D])C([D])([D])[D]
SPLASH splash10-0a4i-5900000000-91475900e7dbc87be343
Source of Spectrum RCM-30-SM4-SM4_1
Wiley ID 1813808